benzoic acid, 4-[6-(3,4-dichlorophenyl)-4-(difluoromethyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]-

SpectraBase Compound ID	Lcojv1Us9T5
InChI	InChI=1S/C21H13Cl2F2N3O2/c1-10-18-14(19(24)25)9-17(12-4-7-15(22)16(23)8-12)26-20(18)28(27-10)13-5-2-11(3-6-13)21(29)30/h2-9,19H,1H3,(H,29,30)
InChIKey	KUIUQCIBCVRBJV-UHFFFAOYSA-N Google Search
Mol Weight	448.26 g/mol
Molecular Formula	C21H13Cl2F2N3O2
Exact Mass	447.035288 g/mol

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SpectraBase Spectrum ID	SZyoZ4CCOW
Name	benzoic acid, 4-[6-(3,4-dichlorophenyl)-4-(difluoromethyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]-
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C21H13Cl2F2N3O2/c1-10-18-14(19(24)25)9-17(12-4-7-15(22)16(23)8-12)26-20(18)28(27-10)13-5-2-11(3-6-13)21(29)30/h2-9,19H,1H3,(H,29,30)
InChIKey	KUIUQCIBCVRBJV-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_22758
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 2239362; UZI_ID: UZI-022766
Temperature	308 °C